methyl (2S)-2-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]propanoate

Systemtic Name: methyl (2S)-2-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]propanoate Openeye Name: methyl (2S)-2-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]propanoate CAS Name: (2S)-2-[1-(2-hydroxy-4-methylphenyl)ethylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[1-(2-hydroxy-4-methylphenyl)ethylamino]propanoate Traditional Name: (2S)-2-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]propionic acid methyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC(C)C(=O)OC)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)N[C@@H](C)C(=O)OC)O

InChI

InChI=1S/C13H19NO3/c1-8-5-6-11(12(15)7-8)9(2)14-10(3)13(16)17-4/h5-7,9-10,14-15H,1-4H3/t9?,10-/m0/s1